Geometry & MOs

Info

ID:	282814
PubChem CID:	103940706
Reduced:	ClNOC16H24 (1)
Stoich.:	ABCD16E24 (1)
Weight, g/mol:	296.173607
ΔH_f, kcal/mol:	-63.96
Dipole, Da:	5.03
IP(EA), eV:	-8.66(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(1-hydroxy-4,4-dimethylpentan-3-yl)amino]-3-oxopropyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C1CCCCCC1)NCC2=C(C(=CC=C2)Cl)O

DOS

IR

Vibrations