Geometry & MOs

Info

ID:	433706
PubChem CID:	135173846
Reduced:	NOC4H5 (3)
Stoich.:	ABC4D5 (3)
Weight, g/mol:	334.215747
ΔH_f, kcal/mol:	-88.1
Dipole, Da:	3.86
IP(EA), eV:	-9.97(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[[3-[(Z)-2-(methylideneamino)ethenyl]-5-(pyrrolidin-1-ylmethyl)pyridin-2-yl]methyl]aniline

Drug info:

PubChemData

Smile

C/C=C\C(=NC=C)C(=O)NC1CCC(=O)NC1=O

DOS

IR

Vibrations