Geometry & MOs

Info

ID:	368286
PubChem CID:	127327870
Reduced:	ON6C16H28 (1)
Stoich.:	AB6C16D28 (1)
Weight, g/mol:	324.195011
ΔH_f, kcal/mol:	-8.94
Dipole, Da:	5.13
IP(EA), eV:	-8.36(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)N2CCC(C2)C3=CN(N=C3)C)C

DOS

IR

Vibrations