Geometry & MOs

Info

ID:	348852
PubChem CID:	127274500
Reduced:	N2O4C19H34 (1)
Stoich.:	A2B4C19D34 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-216.39
Dipole, Da:	2.74
IP(EA), eV:	-9.25(1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-(2-methyl-1,4-oxazepane-4-carbonyl)-6,7-dihydro-5H-1-benzofuran-4-one

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)CCC(C)CC(=O)N2CCCOC(C2)C

DOS

IR

Vibrations