Geometry & MOs

Info

ID:	257204
PubChem CID:	103144374
Reduced:	NOC7H8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	234.173213
ΔH_f, kcal/mol:	-50.87
Dipole, Da:	3.24
IP(EA), eV:	-7.87(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)-3-methylpentanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)C2=COC(=C2)C)C)N

DOS

IR

Vibrations