Geometry & MOs

Info

ID:	55265
PubChem CID:	17389979
Reduced:	N2O5C14H20 (1)
Stoich.:	A2B5C14D20 (1)
Weight, g/mol:	206.141913
ΔH_f, kcal/mol:	-188.08
Dipole, Da:	8.86
IP(EA), eV:	-9.41(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-methoxyphenyl)pyrrolidin-3-yl]methanamine

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(C2)CN.C(=O)(C(=O)O)O

DOS

IR

Vibrations