Geometry & MOs

Info

ID:	323678
PubChem CID:	126675718
Reduced:	ON2C13H16 (1)
Stoich.:	AB2C13D16 (1)
Weight, g/mol:	419.218206
ΔH_f, kcal/mol:	9.29
Dipole, Da:	3.99
IP(EA), eV:	-9.21(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(Z)-3-amino-2-[[3-(6-methylpyrazin-2-yl)oxyphenyl]methyliminomethyl]prop-2-enyl]-6-hydrazinylpyridine-2,5-diamine

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C(CCO)C2=CC=CC=C2

DOS

IR

Vibrations