Geometry & MOs

Info

ID:	206003
PubChem CID:	80187689
Reduced:	FNO4H14C15 (1)
Stoich.:	ABC4D14E15 (1)
Weight, g/mol:	219.173548
ΔH_f, kcal/mol:	-173.03
Dipole, Da:	3.03
IP(EA), eV:	-8.82(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-[(3,3-dimethylpyrrolidin-1-yl)methyl]pyridin-3-yl]methanamine

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)F)NC(=O)C2=C(C=C(C=C2)OC)O

DOS

IR

Vibrations