Geometry & MOs

Info

ID:	174494
PubChem CID:	75772921
Reduced:	ClFO2N3H23C25 (1)
Stoich.:	ABC2D3E23F25 (1)
Weight, g/mol:	473.231456
ΔH_f, kcal/mol:	-71.18
Dipole, Da:	3.75
IP(EA), eV:	-9.11(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-dimethoxyphenyl)methyl]-3-(6-oxo-2,4-diphenyl-1,3-diazinan-1-yl)propanamide

Drug info:

PubChemData

Smile

C1C(NC(N(C1=O)CCC(=O)NC2=C(C=C(C=C2)Cl)F)C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations