Geometry & MOs

Info

ID:	355316
PubChem CID:	127288293
Reduced:	ON2C9H14 (2)
Stoich.:	AB2C9D14 (2)
Weight, g/mol:	322.179361
ΔH_f, kcal/mol:	-71.04
Dipole, Da:	3.23
IP(EA), eV:	-9.59(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(1-phenylcyclobutyl)acetamide

Drug info:

PubChemData

Smile

CC1CCCCC1OCCNC(=O)CN2CCC3=CN=CN=C3C2

DOS

IR

Vibrations