Geometry & MOs

Info

ID:	431268
PubChem CID:	135171339
Reduced:	NC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	148.100048
ΔH_f, kcal/mol:	57.63
Dipole, Da:	1.28
IP(EA), eV:	-7.97(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethenyl-3-propan-2-yl-1,2-dihydroazete-2-carbonitrile

Drug info:

PubChemData

Smile

C=C1CC2=C(C=C3C(=C2)CC=C3N)C=C1N

DOS

IR

Vibrations