Geometry & MOs

Info

ID:	324279
PubChem CID:	126677295
Reduced:	PN3O5C16H34 (1)
Stoich.:	AB3C5D16E34 (1)
Weight, g/mol:	362.165523
ΔH_f, kcal/mol:	-311.36
Dipole, Da:	5.9
IP(EA), eV:	-8.92(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[(1Z)-buta-1,3-dienyl]amino]-1-pyrrolo[3,2-c]pyridin-1-ylethylidene]-5-fluoro-6-methylpyridine-2-carboximidamide

Drug info:

PubChemData

Smile

CC(C)(CCOC(C)(C)C(=O)N1CCN(CC1)P(=O)(N(C)C)OC)O

DOS

IR

Vibrations