Geometry & MOs

Info

ID:	416015
PubChem CID:	135089020
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	366.139113
ΔH_f, kcal/mol:	-82.02
Dipole, Da:	8.38
IP(EA), eV:	-9.22(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(C(C1)C(=O)O)CC2=CC=CC=C2OCCCN3C=CN=C3

DOS

IR

Vibrations