Geometry & MOs

Info

ID:	226284
PubChem CID:	87350370
Reduced:	NO3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	348.129634
ΔH_f, kcal/mol:	-111.66
Dipole, Da:	2.03
IP(EA), eV:	-10.32(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-methylpyridin-4-yl)phenyl]-2-(3-methyl-6-sulfanylidenecyclohexa-1,3-dien-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(=C)C(=O)N(CCO)C(=O)C(=C)C

DOS

IR

Vibrations