Geometry & MOs

Info

ID:	49134
PubChem CID:	11528747
Reduced:	NO2C14H17 (1)
Stoich.:	AB2C14D17 (1)
Weight, g/mol:	231.158292
ΔH_f, kcal/mol:	-53.7
Dipole, Da:	2.3
IP(EA), eV:	-9.46(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1S,2R,3S,5R)-3,5-diamino-2-hydroxycyclopentyl]carbamate

Drug info:

PubChemData

Smile

C1CN(CC1O)C(=O)C2(CC2)C3=CC=CC=C3

DOS

IR

Vibrations