Geometry & MOs

Info

ID:	151946
PubChem CID:	56310779
Reduced:	FN3O3C24H32 (1)
Stoich.:	AB3C3D24E32 (1)
Weight, g/mol:	483.228183
ΔH_f, kcal/mol:	-126.44
Dipole, Da:	3.99
IP(EA), eV:	-8.41(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(2-fluorophenyl)methyl]-1,4-diazepan-1-yl]-N-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC(C1=C(C=CC(=C1)OC)OC)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3F

DOS

IR

Vibrations