Geometry & MOs

Info

ID:	399539
PubChem CID:	135040803
Reduced:	NO2C13H15 (1)
Stoich.:	AB2C13D15 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-68.1
Dipole, Da:	2.39
IP(EA), eV:	-8.25(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1S)-3-hydroxy-1-phenylbutyl]carbamate

Drug info:

PubChemData

Smile

CC1(C2=C(NC3=CC=CC=C31)OCCC2)O

DOS

IR

Vibrations