Geometry & MOs

Info

ID:	144195
PubChem CID:	53330178
Reduced:	N3O4C15H19 (2)
Stoich.:	A3B4C15D19 (2)
Weight, g/mol:	463.06439
ΔH_f, kcal/mol:	-307.1
Dipole, Da:	6.23
IP(EA), eV:	-9.35(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-bromophenyl)-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-(2,3-dihydro-1H-inden-1-yl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C(N1C=C(N=C1)CC(C(=O)N2CCCC2C(=O)N)NC(=O)C3CCC(=O)N3)OC(=O)C(C)(C)C4=CC=CC=C4

DOS

IR

Vibrations