Geometry & MOs

Info

ID:	298516
PubChem CID:	117650540
Reduced:	NPO2C7H12 (1)
Stoich.:	ABC2D7E12 (1)
Weight, g/mol:	146.084398
ΔH_f, kcal/mol:	-51.91
Dipole, Da:	2.14
IP(EA), eV:	-8.5(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1Z)-buta-1,3-dienyl]pyridin-3-amine

Drug info:

PubChemData

Smile

C1CN(C[C@H]([C@@H]1CO)O)C#P

DOS

IR

Vibrations