Geometry & MOs

Info

ID:	330596
PubChem CID:	127248003
Reduced:	SN2O2C15H22 (1)
Stoich.:	AB2C2D15E22 (1)
Weight, g/mol:	302.163043
ΔH_f, kcal/mol:	-66.89
Dipole, Da:	5.83
IP(EA), eV:	-8.82(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)CC1(CCN(C1)C(=O)C2=CC3=C(S2)CCC3)O

DOS

IR

Vibrations