Geometry & MOs

Info

ID:	282525
PubChem CID:	103929187
Reduced:	OCl2N2C15H22 (1)
Stoich.:	AB2C2D15E22 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	-66.64
Dipole, Da:	4.59
IP(EA), eV:	-9.46(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N,3,3-trimethyl-N-(3-phenoxypropyl)butanamide

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)Cl)Cl)N(C)C(=O)[C@@H](C(C)(C)C)N

DOS

IR

Vibrations