Geometry & MOs

Info

ID:	323974
PubChem CID:	126676701
Reduced:	NO3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	408.274993
ΔH_f, kcal/mol:	-121.41
Dipole, Da:	2.37
IP(EA), eV:	-9.52(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(Z)-3-amino-2-[[3-(piperidin-4-ylmethyl)phenyl]methyliminomethyl]prop-2-enyl]-6-hydrazinylpyridine-2,5-diamine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)CO)C2CC2

DOS

IR

Vibrations