Geometry & MOs

Info

ID:	290426
PubChem CID:	104496633
Reduced:	ON2C16H34 (1)
Stoich.:	AB2C16D34 (1)
Weight, g/mol:	286.115127
ΔH_f, kcal/mol:	-100.34
Dipole, Da:	2.06
IP(EA), eV:	-8.63(2.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(3-ethylpyrrolidin-1-yl)sulfonyl-4-fluorophenyl]methanamine

Drug info:

PubChemData

Smile

CCCC1CCN(C1)C(C)CC(C)(CO)NCCC

DOS

IR

Vibrations