Geometry & MOs

Info

ID:	433940
PubChem CID:	135174087
Reduced:	O3N6C30H32 (1)
Stoich.:	A3B6C30D32 (1)
Weight, g/mol:	353.140723
ΔH_f, kcal/mol:	-18.98
Dipole, Da:	7.42
IP(EA), eV:	-7.96(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-2-methylphenyl)-2-(pyrrolidin-1-ylmethyl)pyrido[3,4-b]pyrazin-5-amine

Drug info:

PubChemData

Smile

CC/C=C\1/C(=C(/N)\N=C(/C)\NC2=CC3=C(C=C2)C(=O)C=C(O3)C)/N(C(=O)N1C(C)C)C4=CC5=C(C=C4)NC=C5

DOS

IR

Vibrations