Geometry & MOs

Info

ID:	362355
PubChem CID:	127307426
Reduced:	ON5C16H27 (1)
Stoich.:	AB5C16D27 (1)
Weight, g/mol:	320.23246
ΔH_f, kcal/mol:	-15.47
Dipole, Da:	3.42
IP(EA), eV:	-8.57(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,4-dimethylpiperazin-2-yl)methyl]-2-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CN=CC=C1)N(C)C(=O)NCC2CN(CCN2C)C

DOS

IR

Vibrations