Geometry & MOs

Info

ID:	69080
PubChem CID:	46517823
Reduced:	SO2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	331.081305
ΔH_f, kcal/mol:	-58.37
Dipole, Da:	3.15
IP(EA), eV:	-9.08(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,5-trimethyl-N-(2-thiophen-2-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)C2=C(C3=C(N=C(N=C3S2)C)C)C

DOS

IR

Vibrations