Geometry & MOs

Info

ID:	324280
PubChem CID:	126677308
Reduced:	FN6H19C20 (1)
Stoich.:	AB6C19D20 (1)
Weight, g/mol:	314.127994
ΔH_f, kcal/mol:	110.64
Dipole, Da:	4.51
IP(EA), eV:	-8.99(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[(Z)-pyrrolo[3,2-c]pyridin-1-yl(pyrrol-2-ylidene)methyl]pyridine-2-carboximidamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(=N)N=C(CN/C=C\C=C)N2C=CC3=C2C=CN=C3)F

DOS

IR

Vibrations