Geometry & MOs

Info

ID:	151071
PubChem CID:	53790768
Reduced:	SN2O3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	331.251129
ΔH_f, kcal/mol:	-85.99
Dipole, Da:	5.33
IP(EA), eV:	-9.25(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-(6-cycloheptylhexyl)carbamate

Drug info:

PubChemData

Smile

CCOC(=O)C1C2C=CN=C3C2(CCC=C3)SC1C(=O)CCCN

DOS

IR

Vibrations