Geometry & MOs

Info

ID:	281630
PubChem CID:	103914143
Reduced:	Cl2N2O2C13H18 (1)
Stoich.:	A2B2C2D13E18 (1)
Weight, g/mol:	272.133634
ΔH_f, kcal/mol:	-102.31
Dipole, Da:	3.08
IP(EA), eV:	-9.65(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2,4-difluorophenyl)-2-hydroxyethyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(C1=C(C=CC(=C1)Cl)Cl)O

DOS

IR

Vibrations