Geometry & MOs

Info

ID:	330073
PubChem CID:	127247060
Reduced:	SN5C14H19 (1)
Stoich.:	AB5C14D19 (1)
Weight, g/mol:	330.18559
ΔH_f, kcal/mol:	76.8
Dipole, Da:	3.88
IP(EA), eV:	-8.62(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-[(2-fluoro-3-methoxyphenyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyrazin-2-amine

Drug info:

PubChemData

Smile

CN(C)C1=NC(=CN=C1)C2CCCN2CC3=NC=CS3

DOS

IR

Vibrations