Geometry & MOs

Info

ID:	356683
PubChem CID:	127292164
Reduced:	ON4C16H26 (1)
Stoich.:	AB4C16D26 (1)
Weight, g/mol:	240.183778
ΔH_f, kcal/mol:	-48.67
Dipole, Da:	4.66
IP(EA), eV:	-9.2(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cycloheptyl-1-methyl-1-(oxolan-3-yl)urea

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(=O)N2CCCCC2C3=NC=CN3

DOS

IR

Vibrations