Geometry & MOs

Info

ID:	391681
PubChem CID:	135008309
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	229.131408
ΔH_f, kcal/mol:	-113.21
Dipole, Da:	3.91
IP(EA), eV:	-9.0(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-acetyl-4-imino-4-propan-2-yloxybutanoate

Drug info:

PubChemData

Smile

COC(=O)C1(CCCC(C1)C2=CCCCC2)NC(=O)C3=CC=CC=N3

DOS

IR

Vibrations