Geometry & MOs

Info

ID:	28124
PubChem CID:	825732
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	338.153147
ΔH_f, kcal/mol:	-105.82
Dipole, Da:	2.49
IP(EA), eV:	-8.1(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[cyano-(4-piperidin-1-ylphenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]propanedinitrile

Drug info:

PubChemData

Smile

CC1=C(N(C2=C1C=C(C=C2)OC)CCC(=O)O)C

DOS

IR

Vibrations