Geometry & MOs

Info

ID:	281639
PubChem CID:	103914152
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	168.126263
ΔH_f, kcal/mol:	-85.47
Dipole, Da:	5.32
IP(EA), eV:	-9.34(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(but-2-ynylamino)-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC1C2=CC=CC=C2CCO1

DOS

IR

Vibrations