Geometry & MOs

Info

ID:	132063
PubChem CID:	51301059
Reduced:	SN4O5C15H24 (1)
Stoich.:	AB4C5D15E24 (1)
Weight, g/mol:	386.195405
ΔH_f, kcal/mol:	-165.87
Dipole, Da:	6.09
IP(EA), eV:	-9.05(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-3-nitro-4-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)C2CCN(CC2)CCS(=O)(=O)CCC(=O)N

DOS

IR

Vibrations