Geometry & MOs

Info

ID:	163747
PubChem CID:	74374074
Reduced:	SN2O4C25H26 (1)
Stoich.:	AB2C4D25E26 (1)
Weight, g/mol:	354.140199
ΔH_f, kcal/mol:	-87.32
Dipole, Da:	4.61
IP(EA), eV:	-9.03(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-dimethyl-3-(2-methylprop-2-enyl)-6-(2-phenylethenyl)-4a,7a-dihydrothieno[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC(C)(C(C1=CC=CC=C1)C2=CC=C(C=C2)OC(=O)C3CCCO3)C(=O)NC4=NC=CS4

DOS

IR

Vibrations