Geometry & MOs

Info

ID:	143365
PubChem CID:	53197180
Reduced:	SO2N5C25H27 (1)
Stoich.:	AB2C5D25E27 (1)
Weight, g/mol:	339.104148
ΔH_f, kcal/mol:	28.33
Dipole, Da:	4.38
IP(EA), eV:	-8.22(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-3-cyclopropyl-6-methyl-4-oxothieno[3,2-d]pyrimidine-7-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC(=O)N2CCN(CC2)C3=NC4=C(S3)C(=NN4C5=CC=C(C=C5)OC)C

DOS

IR

Vibrations