Geometry & MOs

Info

ID:	292566
PubChem CID:	116933601
Reduced:	NC8H14 (2)
Stoich.:	AB8C14 (2)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	-27.71
Dipole, Da:	1.52
IP(EA), eV:	-8.85(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzoxazol-6-yl)-3-methylbutane-1,3-diamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(C)(C)C)C(CC(C)(C)N)N

DOS

IR

Vibrations