Geometry & MOs

Info

ID:	286735
PubChem CID:	104222198
Reduced:	N5C16H29 (1)
Stoich.:	A5B16C29 (1)
Weight, g/mol:	289.19026
ΔH_f, kcal/mol:	15.44
Dipole, Da:	1.71
IP(EA), eV:	-8.44(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[5-(ethylaminomethyl)pyrimidin-2-yl]-1,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-2-one

Drug info:

PubChemData

Smile

CC1CN(CC1N(C)C)C2=NC=C(C=N2)CNC(C)(C)C

DOS

IR

Vibrations