Geometry & MOs

Info

ID:	364140
PubChem CID:	127314316
Reduced:	N3O3C11H17 (1)
Stoich.:	A3B3C11D17 (1)
Weight, g/mol:	345.216475
ΔH_f, kcal/mol:	-65.65
Dipole, Da:	7.13
IP(EA), eV:	-9.64(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-methylbutanoyl)piperidin-4-yl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CNC(=O)NCC2(COC2)C

DOS

IR

Vibrations