Geometry & MOs

Info

ID:	200926
PubChem CID:	79462549
Reduced:	SN2O2C16H26 (1)
Stoich.:	AB2C2D16E26 (1)
Weight, g/mol:	296.246378
ΔH_f, kcal/mol:	-105.05
Dipole, Da:	2.56
IP(EA), eV:	-8.96(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[(2-methylcyclopentyl)amino]cyclohexyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCCC(C1)NCC2=CSC=C2

DOS

IR

Vibrations