Geometry & MOs

Info

ID:	348213
PubChem CID:	127273278
Reduced:	O3N5C16H25 (1)
Stoich.:	A3B5C16D25 (1)
Weight, g/mol:	288.150764
ΔH_f, kcal/mol:	-105.44
Dipole, Da:	5.14
IP(EA), eV:	-8.87(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dimethylcyclohexyl)-3-(1,1-dioxothiolan-3-yl)urea

Drug info:

PubChemData

Smile

CC(CN1CCCC1=O)NC(=O)NC2=CC=NN2CC3CCOC3

DOS

IR

Vibrations