Geometry & MOs

Info

ID:	55262
PubChem CID:	17389973
Reduced:	N2O5C11H22 (1)
Stoich.:	A2B5C11D22 (1)
Weight, g/mol:	204.162649
ΔH_f, kcal/mol:	-221.87
Dipole, Da:	6.5
IP(EA), eV:	-9.19(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-ethylphenyl)pyrrolidin-3-yl]methanamine

Drug info:

PubChemData

Smile

COCCCN1CCC(C1)CN.C(=O)(C(=O)O)O

DOS

IR

Vibrations