Geometry & MOs

Info

ID:	122870
PubChem CID:	50825002
Reduced:	SN4O4C23H24 (1)
Stoich.:	AB4C4D23E24 (1)
Weight, g/mol:	480.146741
ΔH_f, kcal/mol:	-73.81
Dipole, Da:	6.31
IP(EA), eV:	-9.0(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4-methoxyphenyl]-2-ethyl-6,7-dihydro-1H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione

Drug info:

PubChemData

Smile

CCC1=C(C2=NC(=O)CCC(=O)N2N1)C3=CC(=C(C=C3)C)S(=O)(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations