Geometry & MOs

Info

ID:	135257
PubChem CID:	51842398
Reduced:	Cl2N2O4C21H26 (1)
Stoich.:	A2B2C4D21E26 (1)
Weight, g/mol:	495.252192
ΔH_f, kcal/mol:	-150.6
Dipole, Da:	5.24
IP(EA), eV:	-8.92(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-(tert-butylamino)-1-oxo-3,3-diphenylpropan-2-yl]-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@@H](C1=C(C=CC=C1Cl)Cl)N(CC2=CC=C(O2)C)C(=O)COC

DOS

IR

Vibrations