Geometry & MOs

Info

ID:	338772
PubChem CID:	127259783
Reduced:	NOC12H17 (2)
Stoich.:	ABC12D17 (2)
Weight, g/mol:	235.157229
ΔH_f, kcal/mol:	-73.34
Dipole, Da:	2.27
IP(EA), eV:	-8.54(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylamino)butan-2-yl 2-phenylacetate

Drug info:

PubChemData

Smile

CCCC(N(CCN(CC)CC)C1=CC=CC=C1)OC(=O)CC2=CC=CC=C2

DOS

IR

Vibrations