Geometry & MOs

Info

ID:	202752
PubChem CID:	79720594
Reduced:	OSN2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	264.195011
ΔH_f, kcal/mol:	-24.34
Dipole, Da:	5.49
IP(EA), eV:	-8.39(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-yl-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CN(CC1CCNCC1)C(=O)CSC2=CC=CC=C2

DOS

IR

Vibrations