Geometry & MOs

Info

ID:	27149
PubChem CID:	816069
Reduced:	SN3O4C16H19 (1)
Stoich.:	AB3C4D16E19 (1)
Weight, g/mol:	209.105193
ΔH_f, kcal/mol:	-112.27
Dipole, Da:	9.58
IP(EA), eV:	-8.84(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methylphenyl) N-[(2S)-2-hydroxypropyl]carbamate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N(CC(=O)NC2=CN=CC=C2)S(=O)(=O)C

DOS

IR

Vibrations