Geometry & MOs

Info

ID:	250016
PubChem CID:	103093553
Reduced:	NOC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	269.189198
ΔH_f, kcal/mol:	-34.77
Dipole, Da:	2.81
IP(EA), eV:	-8.95(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-imidazol-1-ylphenyl)-3-methyl-N-propylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)/C(=C/C1=CC(=CC=C1)O)/C

DOS

IR

Vibrations