Geometry & MOs

Info

ID:	83946
PubChem CID:	49862774
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	346.087291
ΔH_f, kcal/mol:	-53.82
Dipole, Da:	4.24
IP(EA), eV:	-8.48(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[6-(4-chlorophenyl)quinolin-4-yl]amino]phenol

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(=O)N(C2)CC3CCCCC3

DOS

IR

Vibrations