Geometry & MOs

Info

ID:	335824
PubChem CID:	127254686
Reduced:	N4O5C17H18 (1)
Stoich.:	A4B5C17D18 (1)
Weight, g/mol:	380.130697
ΔH_f, kcal/mol:	-168.5
Dipole, Da:	3.0
IP(EA), eV:	-8.68(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-N-[2-(1-methylindol-3-yl)ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

CN1C(=C(N(C1=O)C)C2=CC=C(C=C2)O)C3C(=O)N(C(=O)N(C3=O)C)C

DOS

IR

Vibrations