Geometry & MOs

Info

ID:	368361
PubChem CID:	127328083
Reduced:	ON5C20H33 (1)
Stoich.:	AB5C20D33 (1)
Weight, g/mol:	373.284161
ΔH_f, kcal/mol:	-35.67
Dipole, Da:	4.5
IP(EA), eV:	-8.8(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methylpyrazol-4-yl)-N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(C1C)NC(=O)N2CCC(CC2)N(C)C3=NN=C(C=C3)C

DOS

IR

Vibrations