Geometry & MOs

Info

ID:	437263
PubChem CID:	135220377
Reduced:	NC12H23 (1)
Stoich.:	AB12C23 (1)
Weight, g/mol:	522.245333
ΔH_f, kcal/mol:	-22.1
Dipole, Da:	1.75
IP(EA), eV:	-8.3(1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[N-[(1Z,4E,5Z)-4-ethylidene-3-methylideneocta-1,5,7-trienyl]-C-methylcarbonimidoyl]amino]-4-methylphenyl]-2-methyl-5-(4-methylphenyl)-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCC(/C=C(\C)/CC)/C=C(/CC)\N

DOS

IR

Vibrations