Geometry & MOs

Info

ID:	433828
PubChem CID:	135173971
Reduced:	O3C17H18 (1)
Stoich.:	A3B17C18 (1)
Weight, g/mol:	297.303165
ΔH_f, kcal/mol:	-70.67
Dipole, Da:	3.95
IP(EA), eV:	-9.03(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyethyl)-3-(2,4,4,6,6-pentamethylheptan-2-yl)pyrrolidine

Drug info:

PubChemData

Smile

CCC(=O)COCC1=CC=C(C=C1)OC2=CC=CC=C2

DOS

IR

Vibrations