Geometry & MOs

Info

ID:	364125
PubChem CID:	127314298
Reduced:	N3O3C12H19 (1)
Stoich.:	A3B3C12D19 (1)
Weight, g/mol:	288.104482
ΔH_f, kcal/mol:	-77.75
Dipole, Da:	4.74
IP(EA), eV:	-9.94(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methylthiophen-2-yl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CNC(=O)NCC2(COC2)C

DOS

IR

Vibrations