Geometry & MOs

Info

ID:	188014
PubChem CID:	77654028
Reduced:	ON4C31H42 (1)
Stoich.:	AB4C31D42 (1)
Weight, g/mol:	806.28492
ΔH_f, kcal/mol:	-14.35
Dipole, Da:	3.28
IP(EA), eV:	-8.01(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis[2-[[1-(4-chlorophenyl)-3-(dimethylamino)propyl]amino]-1-methoxy-2-oxo-1-phenylethyl] oxalate

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCC3=C(CC2)C=C(C=C3)N4CCN(CC4)C(=O)C5CCCN5CC6=CC=CC=C6

DOS

IR

Vibrations