Geometry & MOs

Info

ID:	381159
PubChem CID:	134971810
Reduced:	ClOS2N3H14C15 (1)
Stoich.:	ABC2D3E14F15 (1)
Weight, g/mol:	291.026682
ΔH_f, kcal/mol:	40.8
Dipole, Da:	3.43
IP(EA), eV:	-8.82(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-chlorothiophene-2-carbonyl)amino]-1,1-diethylthiourea

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)C(=S)NNC(=O)C3=CC=C(S3)Cl

DOS

IR

Vibrations