Geometry & MOs

Info

ID:	247750
PubChem CID:	103073143
Reduced:	O2N3C12H19 (1)
Stoich.:	A2B3C12D19 (1)
Weight, g/mol:	275.109233
ΔH_f, kcal/mol:	-37.59
Dipole, Da:	3.87
IP(EA), eV:	-8.85(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(cyclopropylamino)methyl]prop-2-enyl]-7-methylthieno[3,2-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC(C)NCC(=C)CN1C(=O)C=CC(=N1)OC

DOS

IR

Vibrations