Geometry & MOs

Info

ID:	172213
PubChem CID:	75480512
Reduced:	ClNOC10H14 (1)
Stoich.:	ABCD10E14 (1)
Weight, g/mol:	211.0667
ΔH_f, kcal/mol:	-67.56
Dipole, Da:	4.22
IP(EA), eV:	-9.26(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[4-(hydroxymethyl)phenyl] N,N-dimethylcarbamothioate

Drug info:

PubChemData

Smile

CC1COC2=CC=CC=C2C1N.Cl

DOS

IR

Vibrations