Geometry & MOs

Info

ID:	332351
PubChem CID:	127250637
Reduced:	N3O3C27H29 (1)
Stoich.:	A3B3C27D29 (1)
Weight, g/mol:	444.160912
ΔH_f, kcal/mol:	-66.15
Dipole, Da:	3.0
IP(EA), eV:	-9.3(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[2-[6-(2,6-difluorophenyl)pyridin-2-yl]morpholin-4-yl]-3-oxopropyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C)(C)C(=O)N2CCOC(C2)C3=CC=CC(=N3)C4=CC(=CC=C4)C(=O)N

DOS

IR

Vibrations