Geometry & MOs

Info

ID:	440965
PubChem CID:	135232502
Reduced:	NO4C18H25 (1)
Stoich.:	AB4C18D25 (1)
Weight, g/mol:	453.194008
ΔH_f, kcal/mol:	-175.69
Dipole, Da:	10.78
IP(EA), eV:	-8.48(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(20,25-dimethyl-7-oxo-10-oxa-14-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosa-1,3,5,8,15(24),16,18(23),19,21-nonaen-25-yl)acetate

Drug info:

PubChemData

Smile

CC1(CCN(C2=C1C(=C(C=C2)C=O)O)CCCCCC(=O)O)C

DOS

IR

Vibrations