Geometry & MOs

Info

ID:	75941
PubChem CID:	48424191
Reduced:	FN3O3C23H28 (1)
Stoich.:	AB3C3D23E28 (1)
Weight, g/mol:	317.199094
ΔH_f, kcal/mol:	-143.22
Dipole, Da:	4.88
IP(EA), eV:	-8.7(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-1-[2-[(4-methoxyphenyl)methyl]pyrrolidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3F

DOS

IR

Vibrations