Geometry & MOs

Info

ID:	35189
PubChem CID:	7979453
Reduced:	SN2O4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	401.140927
ΔH_f, kcal/mol:	-121.26
Dipole, Da:	3.16
IP(EA), eV:	-9.28(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]sulfanyl-N-(3-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(=O)NNC(=O)CCC(=O)C2=C(SC(=C2)C)C

DOS

IR

Vibrations