Geometry & MOs

Info

ID:	401841
PubChem CID:	135052876
Reduced:	ClNO6H16C18 (1)
Stoich.:	ABC6D16E18 (1)
Weight, g/mol:	367.225977
ΔH_f, kcal/mol:	-107.34
Dipole, Da:	6.08
IP(EA), eV:	-8.82(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[4-(dimethylamino)phenyl]ethylideneamino]-N,N-diethyl-5-methoxybenzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=C(CC3=C(O2)C(=CC(=C3)OC)OC)[N+](=O)[O-])Cl

DOS

IR

Vibrations