Geometry & MOs

Info

ID:	165949
PubChem CID:	74617759
Reduced:	ClO2N4C17H27 (1)
Stoich.:	AB2C4D17E27 (1)
Weight, g/mol:	514.267902
ΔH_f, kcal/mol:	-90.12
Dipole, Da:	1.02
IP(EA), eV:	-9.14(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-2-(3-morpholin-4-ylpropyl)-1-(3,4,5-trimethoxyphenyl)-4a,5,6,7,8,8a-hexahydro-1H-chromeno[2,3-c]pyrrole-3,9-dione

Drug info:

PubChemData

Smile

CC1=NN(C(=C1C=CC(=O)NCC(=O)NC(C)(C)C)Cl)CC(C)C

DOS

IR

Vibrations