Geometry & MOs

Info

ID:	281526
PubChem CID:	103913991
Reduced:	ClN2O3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	304.139862
ΔH_f, kcal/mol:	-131.65
Dipole, Da:	3.09
IP(EA), eV:	-9.16(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-hydroxy-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(COC1=CC=CC=C1Cl)O

DOS

IR

Vibrations