Geometry & MOs

Info

ID:	356931
PubChem CID:	127292541
Reduced:	OF2N6C15H26 (1)
Stoich.:	AB2C6D15E26 (1)
Weight, g/mol:	379.294725
ΔH_f, kcal/mol:	-123.12
Dipole, Da:	4.84
IP(EA), eV:	-8.64(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methylpiperazin-1-yl)propan-2-yl]-4-(2-oxo-2-pyrrolidin-1-ylethyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(CN1CCN(CC1)C)NC(=O)N(C)CC2=NC=CN2C(F)F

DOS

IR

Vibrations