Geometry & MOs

Info

ID:	182431
PubChem CID:	76888584
Reduced:	O3N5C16H27 (1)
Stoich.:	A3B5C16D27 (1)
Weight, g/mol:	330.241962
ΔH_f, kcal/mol:	-98.7
Dipole, Da:	7.53
IP(EA), eV:	-9.49(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(piperidin-1-ylmethyl)phenyl]-5-propan-2-ylpyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCN1C2C(C(=O)NC1=O)N(C(=N2)CN(CCO)C3CC3)C

DOS

IR

Vibrations