Geometry & MOs

Info

ID:	185256
PubChem CID:	77277532
Reduced:	NOSC7H15 (1)
Stoich.:	ABCD7E15 (1)
Weight, g/mol:	367.205991
ΔH_f, kcal/mol:	-41.91
Dipole, Da:	3.26
IP(EA), eV:	-8.9(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluoro-4-pyridin-3-ylphenyl)-[2-(1-pyrrolidin-2-ylethyl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CSC(C(CC1CC1)N)O

DOS

IR

Vibrations