Geometry & MOs

Info

ID:	37136
PubChem CID:	8017302
Reduced:	SO2N3C19H23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	364.058317
ΔH_f, kcal/mol:	-20.88
Dipole, Da:	8.8
IP(EA), eV:	-8.7(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-3-[(2,3-dimethylphenyl)carbamothioylamino]thiourea

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC(=O)NNC(=S)NC2=CC=C(C=C2)C(C)C

DOS

IR

Vibrations