Geometry & MOs

Info

ID:	312298
PubChem CID:	126604161
Reduced:	N2O2H16C17 (1)
Stoich.:	A2B2C16D17 (1)
Weight, g/mol:	354.3974
ΔH_f, kcal/mol:	38.9
Dipole, Da:	9.06
IP(EA), eV:	-8.77(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N,6-N-dibutyl-1-N-pentyl-1-N-propan-2-ylheptane-1,6-diamine

Drug info:

PubChemData

Smile

CC(=C)CN(CC#C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)O

DOS

IR

Vibrations