Geometry & MOs

Info

ID:	69544
PubChem CID:	47193722
Reduced:	ClON4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	294.059362
ΔH_f, kcal/mol:	-4.61
Dipole, Da:	2.83
IP(EA), eV:	-8.94(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-4-methylphenyl)-3-(2-thiophen-2-ylethyl)urea

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)NCCN2C=CN=C2)Cl

DOS

IR

Vibrations