Geometry & MOs

Info

ID:	378695
PubChem CID:	134224789
Reduced:	N2O3C8H8 (1)
Stoich.:	A2B3C8D8 (1)
Weight, g/mol:	275.224915
ΔH_f, kcal/mol:	-42.32
Dipole, Da:	5.41
IP(EA), eV:	-10.05(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-(3-methyl-5-pentan-3-ylphenyl)butanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C(=O)O)N=O

DOS

IR

Vibrations