Geometry & MOs

Info

ID:

326546

PubChem CID:

126687753

Reduced:

SN8O11C48H72 (1)

Stoich.:

AB8C11D48E72 (1)

Weight, g/mol:

359.132865

ΔHf, kcal/mol:

-483.67

Dipole, Da:

4.1

IP(EA), eV:

 -8.86(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(3S)-3-[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]-3-(methoxymethoxy)-N-methylpropanamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC(=O)N(C)[C@H](CO)C(=O)N[C@@H](C(=O)NCC(=O)N(C)[C@H]1C2=CC(=C(C=C2)O)C3=C(C=CC(=C3)C[C@H](NC(=O)[C@@H](NC1=O)C)C(=O)NC(C=O)SC)O)N

DOS

IR

Vibrations