Geometry & MOs

Info

ID:	131290
PubChem CID:	51187260
Reduced:	O2N5C21H25 (1)
Stoich.:	A2B5C21D25 (1)
Weight, g/mol:	357.114713
ΔH_f, kcal/mol:	-17.22
Dipole, Da:	6.92
IP(EA), eV:	-9.3(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methoxyphenyl)propyl]-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=NN=C2N1C=CC=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

DOS

IR

Vibrations