Geometry & MOs

Info

ID:	178100
PubChem CID:	76277445
Reduced:	SN4O5C24H30 (1)
Stoich.:	AB4C5D24E30 (1)
Weight, g/mol:	438.074927
ΔH_f, kcal/mol:	-183.26
Dipole, Da:	4.85
IP(EA), eV:	-8.14(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(dicyclopropylmethylamino)-2-oxoethyl] 2-(5,6-dichloro-1,3-dioxoisoindol-2-yl)propanoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3=CC=C(C=C3)NC(=O)NCC4CCCO4

DOS

IR

Vibrations