Geometry & MOs

Info

ID:	281829
PubChem CID:	103914429
Reduced:	SN2O4C13H28 (1)
Stoich.:	AB2C4D13E28 (1)
Weight, g/mol:	334.192629
ΔH_f, kcal/mol:	-228.92
Dipole, Da:	5.09
IP(EA), eV:	-9.19(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[(2-methylsulfonylcyclopentyl)amino]butan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(CCNC(C)CS(=O)(=O)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations