Geometry & MOs

Info

ID:	148148
PubChem CID:	53787810
Reduced:	NO5C18H31 (1)
Stoich.:	AB5C18D31 (1)
Weight, g/mol:	300.183778
ΔH_f, kcal/mol:	-186.76
Dipole, Da:	2.99
IP(EA), eV:	-9.33(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-benzyl-N-(3-cyanocyclopentyl)carbamate

Drug info:

PubChemData

Smile

CCCCCCC(CCC1CC2=C(CC2C1O)NOCC(=O)O)O

DOS

IR

Vibrations