Geometry & MOs

Info

ID:	138869
PubChem CID:	52437121
Reduced:	O2N6C17H26 (1)
Stoich.:	A2B6C17D26 (1)
Weight, g/mol:	448.085971
ΔH_f, kcal/mol:	-27.56
Dipole, Da:	5.1
IP(EA), eV:	-8.3(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-oxopyrrolidin-1-yl)ethyl 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate

Drug info:

PubChemData

Smile

CCN1C2=C(C(=N1)C)N=C(N=C2NCC(=O)N3CCOCC3)C(C)C

DOS

IR

Vibrations