Geometry & MOs

Info

ID:	135175
PubChem CID:	51829103
Reduced:	SN2O4C26H34 (1)
Stoich.:	AB2C4D26E34 (1)
Weight, g/mol:	326.293328
ΔH_f, kcal/mol:	-150.13
Dipole, Da:	8.8
IP(EA), eV:	-9.14(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[butanoyl(tert-butyl)amino]-N-tert-butyl-3-ethylpentanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)[C@@H](C2=CC=CC=C2C)N(C(=O)C=C(C)C)C(C)(C)C

DOS

IR

Vibrations