Geometry & MOs

Info

ID:	328410
PubChem CID:	126706436
Reduced:	N4O4C25H32 (1)
Stoich.:	A4B4C25D32 (1)
Weight, g/mol:	377.223594
ΔH_f, kcal/mol:	-108.59
Dipole, Da:	5.37
IP(EA), eV:	-8.15(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropanoylamino)ethyl 2,2-dimethyl-4-[(2-methylpropan-2-yl)oxymethoxy]-4-sulfanylpentanoate

Drug info:

PubChemData

Smile

CCOC1=C(C=C2CCN(N=C(C2=C1)C3=CC=C(C=C3)N4CCC(CC4)O)C(=O)NC)OC

DOS

IR

Vibrations