Geometry & MOs

Info

ID:	349583
PubChem CID:	127275735
Reduced:	N2O3C15H22 (1)
Stoich.:	A2B3C15D22 (1)
Weight, g/mol:	320.209993
ΔH_f, kcal/mol:	-119.56
Dipole, Da:	4.08
IP(EA), eV:	-9.13(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(2,6,6-trimethyl-5,7-dihydro-4H-1-benzofuran-4-yl)-1,4-oxazepane-4-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)NC2CCCC3=C2C=CO3

DOS

IR

Vibrations