Geometry & MOs

Info

ID:	296218
PubChem CID:	117561291
Reduced:	NO5C13H17 (1)
Stoich.:	AB5C13D17 (1)
Weight, g/mol:	212.082874
ΔH_f, kcal/mol:	-201.4
Dipole, Da:	8.11
IP(EA), eV:	-8.96(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-ethyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NCC(CC(=O)O)C(=O)O

DOS

IR

Vibrations