Geometry & MOs

Info

ID:	216025
PubChem CID:	85085596
Reduced:	ON3C12H13 (1)
Stoich.:	AB3C12D13 (1)
Weight, g/mol:	215.131014
ΔH_f, kcal/mol:	52.16
Dipole, Da:	5.43
IP(EA), eV:	-9.34(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hepta-2,5-dienylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=NO)CN2C=CN=C2

DOS

IR

Vibrations