Geometry & MOs

Info

ID:	281674
PubChem CID:	103914204
Reduced:	O2N3C11H21 (1)
Stoich.:	A2B3C11D21 (1)
Weight, g/mol:	182.141913
ΔH_f, kcal/mol:	-93.76
Dipole, Da:	3.09
IP(EA), eV:	-9.59(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-2-(pent-4-ynylamino)butanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCCC(=O)NC1CC1

DOS

IR

Vibrations