Geometry & MOs

Info

ID:	420465
PubChem CID:	135113286
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	352.123463
ΔH_f, kcal/mol:	40.26
Dipole, Da:	5.2
IP(EA), eV:	-8.76(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(difluoromethoxy)phenyl]-[(3R,4R)-3-hydroxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC=C(N1)CN(CCN(C)C)CC2=CC=CC=C2C3=CC=CO3

DOS

IR

Vibrations