Geometry & MOs

Info

ID:	336251
PubChem CID:	127255258
Reduced:	N2O3C20H28 (1)
Stoich.:	A2B3C20D28 (1)
Weight, g/mol:	393.18009
ΔH_f, kcal/mol:	-95.6
Dipole, Da:	5.6
IP(EA), eV:	-8.44(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-methyl-2,7-dioxo-1,4-dihydropyrazolo[1,5-a]pyrimidin-6-yl)-N-[2-(1-methylindol-3-yl)ethyl]propanamide

Drug info:

PubChemData

Smile

CC(C)C(C1=CC(=C(C=C1)OC)OC)NC(=O)CCCN2C=CC=C2

DOS

IR

Vibrations