Geometry & MOs

Info

ID:	193638
PubChem CID:	78416661
Reduced:	ClO2N3C21H22 (1)
Stoich.:	AB2C3D21E22 (1)
Weight, g/mol:	412.120526
ΔH_f, kcal/mol:	-35.59
Dipole, Da:	4.6
IP(EA), eV:	-8.43(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-3-[2-[5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2,4-oxadiazolidin-3-yl]ethenyl]indole-1-sulfonamide

Drug info:

PubChemData

Smile

C1CC2C(CC1NC=C3C=C(C=CC3=O)CC4=CC=CC=C4Cl)NC(=O)N2

DOS

IR

Vibrations