Geometry & MOs

Info

ID:	71174
PubChem CID:	48414398
Reduced:	O3N5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	411.215806
ΔH_f, kcal/mol:	-3.87
Dipole, Da:	7.02
IP(EA), eV:	-8.89(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]amino]-2-oxoethyl]-2-methylbenzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(CN2CCOCC2)NC(=O)C3=NN(N=C3)C4=CC=CC=C4

DOS

IR

Vibrations