Geometry & MOs

Info

ID:	315649
PubChem CID:	126628324
Reduced:	S2N3O3C17H19 (1)
Stoich.:	A2B3C3D17E19 (1)
Weight, g/mol:	309.092042
ΔH_f, kcal/mol:	-58.9
Dipole, Da:	6.27
IP(EA), eV:	-8.6(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chlorophenyl)-2-methoxy-N-phenylaniline

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)C2=CSC(=N2)NC3=CC(=C(C(=C3)OC)CO)CO

DOS

IR

Vibrations