Geometry & MOs

Info

ID:	206164
PubChem CID:	80216754
Reduced:	N2O3C16H30 (1)
Stoich.:	A2B3C16D30 (1)
Weight, g/mol:	278.215827
ΔH_f, kcal/mol:	-189.5
Dipole, Da:	7.09
IP(EA), eV:	-9.58(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluoro-4-methylphenyl)-3-(2-propan-2-ylpyrrolidin-1-yl)propan-1-amine

Drug info:

PubChemData

Smile

CC1(CCC(CC1)N(C)C(=O)NC(C(=O)O)C(C)(C)C)C

DOS

IR

Vibrations