Geometry & MOs

Info

ID:	296224
PubChem CID:	117561538
Reduced:	N5C13H23 (1)
Stoich.:	A5B13C23 (1)
Weight, g/mol:	319.04326
ΔH_f, kcal/mol:	19.23
Dipole, Da:	2.37
IP(EA), eV:	-8.4(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(2-bromophenyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CCCCN(C)C1=NC(=NC2=C1CNCC2)NC

DOS

IR

Vibrations