Geometry & MOs

Info

ID:	345583
PubChem CID:	127269883
Reduced:	O3N4C20H30 (1)
Stoich.:	A3B4C20D30 (1)
Weight, g/mol:	262.179361
ΔH_f, kcal/mol:	-142.99
Dipole, Da:	2.33
IP(EA), eV:	-8.86(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC2=C(C=C1)NC(=O)CC2)NC(=O)NCCN3CCOC(C3)(C)C

DOS

IR

Vibrations