Geometry & MOs

Info

ID:	138451
PubChem CID:	52368969
Reduced:	N3O4C18H21 (1)
Stoich.:	A3B4C18D21 (1)
Weight, g/mol:	371.039435
ΔH_f, kcal/mol:	-53.22
Dipole, Da:	9.24
IP(EA), eV:	-9.08(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(N-(2-chlorophenyl)sulfonyl-4-fluoroanilino)acetate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)N(C)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)C

DOS

IR

Vibrations