Geometry & MOs

Info

ID:	214147
PubChem CID:	81087035
Reduced:	F2N2O2C13H18 (1)
Stoich.:	A2B2C2D13E18 (1)
Weight, g/mol:	243.231063
ΔH_f, kcal/mol:	-183.96
Dipole, Da:	1.65
IP(EA), eV:	-9.39(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(aminomethyl)-N-[2-(dimethylamino)-3-methylbutyl]pentanamide

Drug info:

PubChemData

Smile

CC(CC(=O)NCC1=CC=C(C=C1)OC(F)F)CN

DOS

IR

Vibrations