Geometry & MOs

Info

ID:	315199
PubChem CID:	126624888
Reduced:	NOH5C6 (2)
Stoich.:	ABC5D6 (2)
Weight, g/mol:	351.288577
ΔH_f, kcal/mol:	-6.31
Dipole, Da:	6.04
IP(EA), eV:	-9.64(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclodecyl-3-(cyclooctylcarbamoyl)urea

Drug info:

PubChemData

Smile

C\1=C\C=C/C(=C\C=C1)/C2=NC(=CC(=O)N2)O

DOS

IR

Vibrations