Geometry & MOs

Info

ID:	134870
PubChem CID:	51772601
Reduced:	N2O3C24H30 (1)
Stoich.:	A2B3C24D30 (1)
Weight, g/mol:	390.288243
ΔH_f, kcal/mol:	-107.16
Dipole, Da:	4.41
IP(EA), eV:	-9.14(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-N-methyl-N-[(2R)-1-oxo-1-(2,4,4-trimethylpentan-2-ylamino)heptan-2-yl]benzamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)[C@@H](C(=O)NC2CCCCC2)N(C)C(=O)C3=CC=CC=C3O

DOS

IR

Vibrations