Geometry & MOs

Info

ID:	214133
PubChem CID:	81086991
Reduced:	ON2F3C12H23 (1)
Stoich.:	AB2C3D12E23 (1)
Weight, g/mol:	252.183778
ΔH_f, kcal/mol:	-243.77
Dipole, Da:	2.81
IP(EA), eV:	-9.3(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methyl-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-ylbutanamide

Drug info:

PubChemData

Smile

CCC(CC)N(CC(F)(F)F)C(=O)CC(C)CN

DOS

IR

Vibrations