Geometry & MOs

Info

ID:	364148
PubChem CID:	127314324
Reduced:	O2N5C16H23 (1)
Stoich.:	A2B5C16D23 (1)
Weight, g/mol:	300.195011
ΔH_f, kcal/mol:	-23.8
Dipole, Da:	2.9
IP(EA), eV:	-9.23(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)C(C1=NN=C2N1C=CC=C2)NC(=O)NCC3(COC3)C

DOS

IR

Vibrations