Geometry & MOs

Info

ID:	321372
PubChem CID:	126665904
Reduced:	ClFO2N3H11C14 (1)
Stoich.:	ABC2D3E11F14 (1)
Weight, g/mol:	241.146664
ΔH_f, kcal/mol:	-30.67
Dipole, Da:	1.54
IP(EA), eV:	-9.71(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3-aminophenyl)-4-propan-2-ylphenyl]methanol

Drug info:

PubChemData

Smile

CC1=NOC2=C1C(=O)N(N=C2C)CC3=C(C=C(C=C3)Cl)F

DOS

IR

Vibrations