Geometry & MOs

Info

ID:	345388
PubChem CID:	127269688
Reduced:	NOC3H5 (4)
Stoich.:	ABC3D5 (4)
Weight, g/mol:	364.258674
ΔH_f, kcal/mol:	-128.76
Dipole, Da:	5.53
IP(EA), eV:	-8.92(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2-methoxyethyl)pyrazol-3-yl]-4-[(4-methylpiperazin-1-yl)methyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

COCCN1C=CC(=N1)NC(=O)NCC2COCCO2

DOS

IR

Vibrations