Geometry & MOs

Info

ID:	231938
PubChem CID:	87574957
Reduced:	ClO2N6H15C20 (1)
Stoich.:	AB2C6D15E20 (1)
Weight, g/mol:	398.095269
ΔH_f, kcal/mol:	45.38
Dipole, Da:	4.11
IP(EA), eV:	-9.71(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(3,4-dichlorophenyl)-2-[4-[3-(dimethylamino)phenyl]phenyl]acetaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(=O)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)Cl)NC=O

DOS

IR

Vibrations