Geometry & MOs

Info

ID:	373753
PubChem CID:	131319685
Reduced:	NOC10H13 (1)
Stoich.:	ABC10D13 (1)
Weight, g/mol:	213.126598
ΔH_f, kcal/mol:	-35.99
Dipole, Da:	2.35
IP(EA), eV:	-8.37(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-(2-methylpiperidin-4-ylidene)-2-pyridin-3-ylacetonitrile

Drug info:

PubChemData

Smile

CC1CC2=C(N1)C(=C(C=C2)C)O

DOS

IR

Vibrations