Geometry & MOs

Info

ID:	281717
PubChem CID:	103914266
Reduced:	NO2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	298.225643
ΔH_f, kcal/mol:	-148.88
Dipole, Da:	3.91
IP(EA), eV:	-9.58(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-hydroxy-3-[(6-methylcyclohex-3-en-1-yl)methoxy]propyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC1=C(OC=C1)C(=O)OC

DOS

IR

Vibrations