Geometry & MOs

Info

ID:	134755
PubChem CID:	51752440
Reduced:	ClN3O3C28H32 (1)
Stoich.:	AB3C3D28E32 (1)
Weight, g/mol:	523.26017
ΔH_f, kcal/mol:	-69.31
Dipole, Da:	4.4
IP(EA), eV:	-8.12(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(1R)-1-[4-(dimethylamino)phenyl]-2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl]-N-(furan-2-ylmethyl)benzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)[C@H](C(=O)NC2CCCCC2)N(CC3=CC=CO3)C(=O)C4=CC=CC=C4Cl

DOS

IR

Vibrations