Geometry & MOs

Info

ID:	315452
PubChem CID:	126626764
Reduced:	FO3H25C27 (1)
Stoich.:	AB3C25D27 (1)
Weight, g/mol:	445.247775
ΔH_f, kcal/mol:	-108.4
Dipole, Da:	7.48
IP(EA), eV:	-9.01(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methanimidoyl-N-[(6-methyl-2-oxo-4-propyl-1H-pyridin-3-yl)methyl]-6-phenyl-2-(propan-2-ylamino)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)C2=C3CCC(C3=C(C=C2)F)OC4=CC=C(C=C4)C5CC5C(=O)O

DOS

IR

Vibrations