Geometry & MOs

Info

ID:	28614
PubChem CID:	828629
Reduced:	ClNOC15H16 (1)
Stoich.:	ABCD15E16 (1)
Weight, g/mol:	275.107692
ΔH_f, kcal/mol:	-23.12
Dipole, Da:	2.76
IP(EA), eV:	-8.74(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-[(1S)-1-(2,4-dimethylanilino)ethyl]phenol

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N[C@H](C)C2=C(C=CC(=C2)Cl)O

DOS

IR

Vibrations