Geometry & MOs

Info

ID:	341937
PubChem CID:	127264630
Reduced:	ClNOC10H14 (1)
Stoich.:	ABCD10E14 (1)
Weight, g/mol:	163.099714
ΔH_f, kcal/mol:	-67.37
Dipole, Da:	7.19
IP(EA), eV:	-9.99(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(1S)-1-aminoethyl]phenyl]ethanone

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=CC=C1)C(=O)C)N.Cl

DOS

IR

Vibrations