Geometry & MOs

Info

ID:	38297
PubChem CID:	8029540
Reduced:	SN2O3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	385.103811
ΔH_f, kcal/mol:	-131.14
Dipole, Da:	3.17
IP(EA), eV:	-8.3(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-2-phenyl-5-[4-(trifluoromethyl)phenyl]-1,5,6,8-tetrahydropyrido[2,3-d]pyrimidine-4,7-dione

Drug info:

PubChemData

Smile

CC(C)NC(=O)NC1=C(C2=C(S1)CCC2)C(=O)OC

DOS

IR

Vibrations