Geometry & MOs

Info

ID:	347215
PubChem CID:	127271756
Reduced:	O2N3C20H33 (1)
Stoich.:	A2B3C20D33 (1)
Weight, g/mol:	381.252861
ΔH_f, kcal/mol:	-95.36
Dipole, Da:	5.95
IP(EA), eV:	-9.35(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-[(6-piperidin-1-ylpyridin-3-yl)methyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCC1OCCNC(=O)C2=CN(N=C2C3CCCCC3)C

DOS

IR

Vibrations