Geometry & MOs

Info

ID:	362946
PubChem CID:	127309952
Reduced:	ON5C23H27 (1)
Stoich.:	AB5C23D27 (1)
Weight, g/mol:	338.210661
ΔH_f, kcal/mol:	27.08
Dipole, Da:	5.14
IP(EA), eV:	-8.68(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-2,3-dihydro-1H-inden-1-yl)-3-(4-methylpyrazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CC2=CC=CC=C2C1NC(=O)N3CCN(CC3)CC4=CN5C=CC=CC5=N4

DOS

IR

Vibrations