Geometry & MOs

Info

ID:	273850
PubChem CID:	103805368
Reduced:	N2O2F3C11H19 (1)
Stoich.:	A2B2C3D11E19 (1)
Weight, g/mol:	330.01345
ΔH_f, kcal/mol:	-261.42
Dipole, Da:	4.16
IP(EA), eV:	-9.5(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(aminomethyl)piperidin-1-yl]-(2-bromo-5-chlorophenyl)methanone

Drug info:

PubChemData

Smile

C1CN(CCC1CN)C(=O)CCOCC(F)(F)F

DOS

IR

Vibrations