Geometry & MOs

Info

ID:	323045
PubChem CID:	126671891
Reduced:	O3N5C25H31 (1)
Stoich.:	A3B5C25D31 (1)
Weight, g/mol:	393.216475
ΔH_f, kcal/mol:	-26.58
Dipole, Da:	7.79
IP(EA), eV:	-9.44(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[4-(4-pyrrolidin-1-ylpiperidine-1-carbonyl)phenyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)[C@@H](C(C)C)C(=O)CO

DOS

IR

Vibrations