Geometry & MOs

Info

ID:	304039
PubChem CID:	124491620
Reduced:	NOF2C6H11 (1)
Stoich.:	ABC2D6E11 (1)
Weight, g/mol:	250.168128
ΔH_f, kcal/mol:	-167.57
Dipole, Da:	3.68
IP(EA), eV:	-9.64(2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1S,2S)-1-amino-1-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

C[C@@H]([C@H]1CC(CN1)(F)F)O

DOS

IR

Vibrations