Geometry & MOs

Info

ID:	33194
PubChem CID:	7885355
Reduced:	N2O4C21H24 (1)
Stoich.:	A2B4C21D24 (1)
Weight, g/mol:	358.109962
ΔH_f, kcal/mol:	-144.01
Dipole, Da:	6.61
IP(EA), eV:	-9.61(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-[(7S)-7-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC(=O)N[C@@H](C)C2=CC=CC=C2)C

DOS

IR

Vibrations