Geometry & MOs

Info

ID:	288515
PubChem CID:	104318001
Reduced:	ON3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	-27.92
Dipole, Da:	3.29
IP(EA), eV:	-8.69(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-amino-N-propylanilino)butan-2-ol

Drug info:

PubChemData

Smile

CC(CCN(C)C1=C(C=NC=C1)N)O

DOS

IR

Vibrations