Geometry & MOs

Info

ID:	34250
PubChem CID:	7890496
Reduced:	ClN2O3H21C24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	413.093309
ΔH_f, kcal/mol:	-64.78
Dipole, Da:	5.25
IP(EA), eV:	-8.08(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-phenoxyphenyl)methyl 2-methoxy-5-sulfamoylbenzoate

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)NC(=O)[C@H](C)OC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C41

DOS

IR

Vibrations