Geometry & MOs

Info

ID:	323544
PubChem CID:	126675380
Reduced:	NO2C23H31 (1)
Stoich.:	AB2C23D31 (1)
Weight, g/mol:	302.185509
ΔH_f, kcal/mol:	-56.95
Dipole, Da:	2.68
IP(EA), eV:	-8.39(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[(Z)-1-amino-3-(1-methylpiperidin-4-yl)iminoprop-1-en-2-yl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C)CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)COC3CCCC3

DOS

IR

Vibrations