Geometry & MOs

Info

ID:	435661
PubChem CID:	135192091
Reduced:	FNOC17H22 (1)
Stoich.:	ABCD17E22 (1)
Weight, g/mol:	231.137162
ΔH_f, kcal/mol:	-81.3
Dipole, Da:	3.19
IP(EA), eV:	-9.59(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2E,3Z)-2-ethylidene-5-methylhexa-3,5-dienyl]imidazole-4-carboxamide

Drug info:

PubChemData

Smile

CC/C(=C(/C=C(\CC)/CC1=CC(=CC=C1)F)\C(=O)N)/C

DOS

IR

Vibrations