Geometry & MOs

Info

ID:	126730
PubChem CID:	50975251
Reduced:	NOC5H9 (3)
Stoich.:	ABC5D9 (3)
Weight, g/mol:	340.153541
ΔH_f, kcal/mol:	-148.19
Dipole, Da:	2.41
IP(EA), eV:	-9.06(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2,3-dimethyl-1H-indole-7-carbonyl)amino]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetic acid

Drug info:

PubChemData

Smile

CN(C)CCN1CC(CC1=O)C(=O)NCC2CCOCC2

DOS

IR

Vibrations