Geometry & MOs

Info

ID:	341835
PubChem CID:	127264528
Reduced:	ClNS2O6C10H14 (1)
Stoich.:	ABC2D6E10F14 (1)
Weight, g/mol:	311.05209
ΔH_f, kcal/mol:	-250.8
Dipole, Da:	4.76
IP(EA), eV:	-10.01(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(7-bromo-2,3-dihydro-1H-inden-1-yl)carbamate

Drug info:

PubChemData

Smile

CCOS(=O)(=O)C1=CC(=C(C=C1N)Cl)S(=O)(=O)OCC

DOS

IR

Vibrations