Geometry & MOs

Info

ID:	280691
PubChem CID:	103850742
Reduced:	NF3O3C7H12 (1)
Stoich.:	AB3C3D7E12 (1)
Weight, g/mol:	244.178693
ΔH_f, kcal/mol:	-294.1
Dipole, Da:	4.55
IP(EA), eV:	-10.34(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-3-pyrrolidin-1-ylpropanamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)C(F)(F)F

DOS

IR

Vibrations