Geometry & MOs

Info

ID:

225526

PubChem CID:

85852717

Reduced:

N7O9C26H39 (1)

Stoich.:

A7B9C26D39 (1)

Weight, g/mol:

98.084398

ΔHf, kcal/mol:

-412.2

Dipole, Da:

1.64

IP(EA), eV:

-9.73(-0.06)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-but-2-ynyl-1-methylhydrazine

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(CC(=O)N)C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)N)NC(=O)C(CO)N

DOS

IR

Vibrations