Geometry & MOs

Info

ID:	358875
PubChem CID:	127296746
Reduced:	NOC7H13 (3)
Stoich.:	ABC7D13 (3)
Weight, g/mol:	253.215413
ΔH_f, kcal/mol:	-170.95
Dipole, Da:	2.82
IP(EA), eV:	-8.77(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylcyclohexyl)-3-(1-methylpiperidin-4-yl)urea

Drug info:

PubChemData

Smile

CCCOC1CCCN(CC1)C(=O)NCC2(CCCCC2)N3CCOCC3

DOS

IR

Vibrations