Geometry & MOs

Info

ID:	159161
PubChem CID:	57264275
Reduced:	I3N4O6C14H15 (1)
Stoich.:	A3B4C6D14E15 (1)
Weight, g/mol:	448.23262
ΔH_f, kcal/mol:	-168.28
Dipole, Da:	4.69
IP(EA), eV:	-10.11(-2.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopropyl-2,2-bis(3-fluorophenyl)-N-(4-pyridin-3-ylbutyl)butanamide

Drug info:

PubChemData

Smile

CNC(=O)C(CO)NC(=O)C1=C(C(=C(C(=C1I)NC(=O)CN)I)C(=O)O)I

DOS

IR

Vibrations