Geometry & MOs

Info

ID:	159290
PubChem CID:	57269461
Reduced:	N2O3H30C33 (1)
Stoich.:	A2B3C30D33 (1)
Weight, g/mol:	412.12792
ΔH_f, kcal/mol:	10.09
Dipole, Da:	4.89
IP(EA), eV:	-8.62(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-[acetyl(prop-2-enyl)amino]phenyl]disulfanyl]phenyl]-N-prop-2-enylacetamide

Drug info:

PubChemData

Smile

CC(=O)C1=CN(N=C1C2=CC(=CC=C2)OCCC3=CC=CC=C3)C4=CC=CC=C4CC5=CC=C(C=C5)OC

DOS

IR

Vibrations