Geometry & MOs

Info

ID:	274633
PubChem CID:	103810721
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	293.210327
ΔH_f, kcal/mol:	-127.57
Dipole, Da:	5.67
IP(EA), eV:	-9.52(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxy-4-methylpentan-3-yl)-1-piperidin-4-ylpyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(CCO)NC(=O)[C@@H]1CCCCN1

DOS

IR

Vibrations