Geometry & MOs

Info

ID:	282257
PubChem CID:	103920196
Reduced:	N2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	213.097663
ΔH_f, kcal/mol:	-158.4
Dipole, Da:	3.8
IP(EA), eV:	-9.58(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4,4-trifluoro-N-[(2R)-1-hydroxybutan-2-yl]butanamide

Drug info:

PubChemData

Smile

CC[C@H](CO)NC(=O)C1CC(=O)N(C1)CC

DOS

IR

Vibrations