Geometry & MOs

Info

ID:	34276
PubChem CID:	7890606
Reduced:	O4H20C23 (1)
Stoich.:	A4B20C23 (1)
Weight, g/mol:	384.135508
ΔH_f, kcal/mol:	-97.81
Dipole, Da:	3.23
IP(EA), eV:	-9.25(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 2-methoxy-5-sulfamoylbenzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[C@H](C(=O)C2=CC=C(C=C2)C)OC(=O)C3=CC=CC=C3O

DOS

IR

Vibrations