Geometry & MOs

Info

ID:	281568
PubChem CID:	103914056
Reduced:	ON4C14H26 (1)
Stoich.:	AB4C14D26 (1)
Weight, g/mol:	261.147727
ΔH_f, kcal/mol:	-43.57
Dipole, Da:	4.0
IP(EA), eV:	-9.32(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-cyano-2-methoxyphenyl)methylamino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CCC(CC)N1C=CC(=N1)CNC(C(C)C)C(=O)N

DOS

IR

Vibrations