Geometry & MOs

Info

ID:	364143
PubChem CID:	127314319
Reduced:	N2O2F3C16H19 (1)
Stoich.:	A2B2C3D16E19 (1)
Weight, g/mol:	286.179361
ΔH_f, kcal/mol:	-200.73
Dipole, Da:	2.69
IP(EA), eV:	-9.57(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bicyclo[2.2.1]heptanylmethyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxamide

Drug info:

PubChemData

Smile

CC1(COC1)CNC(=O)NC2CC2C3=CC=CC=C3C(F)(F)F

DOS

IR

Vibrations