Geometry & MOs

Info

ID:	446008
PubChem CID:	135271403
Reduced:	FON6C21H21 (1)
Stoich.:	ABC6D21E21 (1)
Weight, g/mol:	362.174276
ΔH_f, kcal/mol:	46.71
Dipole, Da:	3.18
IP(EA), eV:	-8.9(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-N'-[(E)-phenoxy-(4-propylpyrrol-2-ylidene)methyl]pyridine-2-carboximidamide

Drug info:

PubChemData

Smile

CCCCC1=CN2C(=C1)C(=NC(=N2)C3=NC(=CC=C3)OC)NC4=C(C=NC=C4)F

DOS

IR

Vibrations