Geometry & MOs

Info

ID:	412374
PubChem CID:	135085265
Reduced:	IOC13H15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	238.110613
ΔH_f, kcal/mol:	18.52
Dipole, Da:	2.2
IP(EA), eV:	-9.07(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-prop-1-en-2-ylpyridin-4-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/COC/C=C/CI

DOS

IR

Vibrations