Geometry & MOs

Info

ID:	282349
PubChem CID:	103923067
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	326.177647
ΔH_f, kcal/mol:	-60.22
Dipole, Da:	1.86
IP(EA), eV:	-8.8(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[2-(thiadiazol-4-ylmethylamino)cyclohexyl]methyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C1CC1)NCC2=CC=CC=C2C(=O)OC

DOS

IR

Vibrations