Geometry & MOs

Info

ID:	263351
PubChem CID:	103358745
Reduced:	FSN2O2C14H15 (1)
Stoich.:	ABC2D2E14F15 (1)
Weight, g/mol:	306.103814
ΔH_f, kcal/mol:	-111.54
Dipole, Da:	2.11
IP(EA), eV:	-8.18(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-amino-6-methoxy-1-benzothiophen-2-yl)-(3-hydroxy-3-methylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1(CCN(C1)C(=O)C2=C(C3=C(S2)C=CC(=C3)F)N)O

DOS

IR

Vibrations