Geometry & MOs

Info

ID:	139516
PubChem CID:	52545513
Reduced:	O2S3N4H12C20 (1)
Stoich.:	A2B3C4D12E20 (1)
Weight, g/mol:	300.129634
ΔH_f, kcal/mol:	94.34
Dipole, Da:	5.62
IP(EA), eV:	-8.86(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyl-3-(2-thiophen-2-ylphenyl)urea

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)CNC(=O)C4=CC5=C(S4)N=C6N5C=CS6

DOS

IR

Vibrations