Geometry & MOs

Info

ID:	349584
PubChem CID:	127275736
Reduced:	N2O3C18H28 (1)
Stoich.:	A2B3C18D28 (1)
Weight, g/mol:	257.173942
ΔH_f, kcal/mol:	-142.43
Dipole, Da:	4.22
IP(EA), eV:	-8.79(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(dimethylamino)-1-oxopropan-2-yl]-2-methyl-1,4-oxazepane-4-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)NC2CC(CC3=C2C=C(O3)C)(C)C

DOS

IR

Vibrations