Geometry & MOs

Info

ID:	31936
PubChem CID:	3724242
Reduced:	N3O4C26H29 (1)
Stoich.:	A3B4C26D29 (1)
Weight, g/mol:	234.173213
ΔH_f, kcal/mol:	-105.07
Dipole, Da:	3.54
IP(EA), eV:	-8.41(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-bicyclo[3.2.0]hept-2-enylideneamino)heptanamide

Drug info:

PubChemData

Smile

CC(C)CN1CC(=O)N2C(C1=O)CC3=C(C2C4=C(C(=CC=C4)OC)OC)NC5=CC=CC=C35

DOS

IR

Vibrations