Geometry & MOs

Info

ID:	330603
PubChem CID:	127248010
Reduced:	N2O3C17H26 (1)
Stoich.:	A2B3C17D26 (1)
Weight, g/mol:	316.178693
ΔH_f, kcal/mol:	-124.8
Dipole, Da:	3.74
IP(EA), eV:	-8.69(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-[(dimethylamino)methyl]-3-hydroxypyrrolidin-1-yl]-2-(6-methyl-1-benzofuran-3-yl)ethanone

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)CCCC2)C(=O)N3CCC(C3)(CN(C)C)O

DOS

IR

Vibrations