Geometry & MOs

Info

ID:	259157
PubChem CID:	103158406
Reduced:	NOC14H27 (1)
Stoich.:	ABC14D27 (1)
Weight, g/mol:	267.163457
ΔH_f, kcal/mol:	-91.62
Dipole, Da:	2.31
IP(EA), eV:	-9.02(2.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-(4-fluoro-3-methoxyanilino)propan-2-ol

Drug info:

PubChemData

Smile

CC1CCC(C1)NCC(CC2CCCC2)O

DOS

IR

Vibrations