Geometry & MOs

Info

ID:	193990
PubChem CID:	78464578
Reduced:	SN3O4C18H19 (1)
Stoich.:	AB3C4D18E19 (1)
Weight, g/mol:	272.188863
ΔH_f, kcal/mol:	-23.74
Dipole, Da:	6.59
IP(EA), eV:	-8.88(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4,6-trimethylhept-5-enylideneamino)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1O)C)CSCC(=O)NN=CC2=CC(=CC=C2)[N+](=O)[O-]

DOS

IR

Vibrations