Geometry & MOs

Info

ID:	375138
PubChem CID:	131472635
Reduced:	ClNSO3C6H10 (1)
Stoich.:	ABCD3E6F10 (1)
Weight, g/mol:	200.024022
ΔH_f, kcal/mol:	-143.95
Dipole, Da:	6.94
IP(EA), eV:	-10.11(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-chloro-6-hydroxy-4-methylbenzoate

Drug info:

PubChemData

Smile

CC1(CC(=O)NC1)CS(=O)(=O)Cl

DOS

IR

Vibrations