Geometry & MOs

Info

ID:	322350
PubChem CID:	126669886
Reduced:	ClO2N3C17H24 (1)
Stoich.:	AB2C3D17E24 (1)
Weight, g/mol:	376.189926
ΔH_f, kcal/mol:	-80.86
Dipole, Da:	2.39
IP(EA), eV:	-8.96(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-cyclopropyl-N-[(4,6-dimethyl-2-oxo-3H-pyridin-3-yl)methyl]-6H-cyclohepta[b]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

C1CNCCC1N2CC(OC[C@@H]2CC3=CC=C(C=C3)Cl)C(=O)N

DOS

IR

Vibrations