Geometry & MOs

Info

ID:	67996
PubChem CID:	46507573
Reduced:	SN3O3C15H15 (1)
Stoich.:	AB3C3D15E15 (1)
Weight, g/mol:	255.148396
ΔH_f, kcal/mol:	-38.42
Dipole, Da:	6.33
IP(EA), eV:	-8.97(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-methylpyrimidin-4-yl]hydrazine

Drug info:

PubChemData

Smile

C1CSCCN1C2=NC=CN=C2OC3=CC=C(C=C3)C(=O)O

DOS

IR

Vibrations