Geometry & MOs

Info

ID:	299648
PubChem CID:	117688276
Reduced:	SN5O9C31H45 (1)
Stoich.:	AB5C9D31E45 (1)
Weight, g/mol:	184.096026
ΔH_f, kcal/mol:	-347.77
Dipole, Da:	7.47
IP(EA), eV:	-8.6(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2S,4R)-4-azido-2-methylcyclopentyl]carbamic acid

Drug info:

PubChemData

Smile

CCCCCCOC(=O)ON1CC(CC1CNC2=CC=CC=N2)OCC(=O)NCC(C(=O)O)NS(=O)(=O)C3=C(C=C(C=C3C)C)C

DOS

IR

Vibrations