Geometry & MOs

Info

ID:	448308
PubChem CID:	135290038
Reduced:	ClNO5H8C10 (1)
Stoich.:	ABC5D8E10 (1)
Weight, g/mol:	330.173213
ΔH_f, kcal/mol:	-198.02
Dipole, Da:	5.34
IP(EA), eV:	-9.92(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(4-cyclopropyl-2-methoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]benzonitrile

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)NC(=O)CC(=O)O)C(=O)O

DOS

IR

Vibrations