Geometry & MOs

Info

ID:	75508
PubChem CID:	48423573
Reduced:	N2O5C19H28 (1)
Stoich.:	A2B5C19D28 (1)
Weight, g/mol:	279.1293
ΔH_f, kcal/mol:	-173.76
Dipole, Da:	3.23
IP(EA), eV:	-8.46(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC(=C(C=C1)OCC(=O)N(C)C)OC)OCC2CC2

DOS

IR

Vibrations