Geometry & MOs

Info

ID:	30949
PubChem CID:	853885
Reduced:	SN3C5H7 (1)
Stoich.:	AB3C5D7 (1)
Weight, g/mol:	256.10342
ΔH_f, kcal/mol:	26.78
Dipole, Da:	8.43
IP(EA), eV:	-8.4(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-3-phenylthiourea

Drug info:

PubChemData

Smile

CC1=CC(=NC(=S)N1)N

DOS

IR

Vibrations