Geometry & MOs

Info

ID:	128973
PubChem CID:	51064603
Reduced:	SN3O4C19H21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	397.146013
ΔH_f, kcal/mol:	-115.03
Dipole, Da:	7.67
IP(EA), eV:	-8.59(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-N-(3-methoxyphenyl)-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)CCCOC)C(=O)NC3=CC(=CC=C3)OC

DOS

IR

Vibrations