Geometry & MOs

Info

ID:	349581
PubChem CID:	127275733
Reduced:	N3O3C14H25 (1)
Stoich.:	A3B3C14D25 (1)
Weight, g/mol:	311.130363
ΔH_f, kcal/mol:	-153.49
Dipole, Da:	3.79
IP(EA), eV:	-9.29(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[2-(thiophene-2-carbonylamino)ethyl]-1,4-oxazepane-4-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)NCC(=O)N2CCCCC2

DOS

IR

Vibrations