Geometry & MOs

Info

ID:	375028
PubChem CID:	131465253
Reduced:	NO2C13H17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	204.137497
ΔH_f, kcal/mol:	-48.55
Dipole, Da:	2.0
IP(EA), eV:	-8.72(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-aminoethyl)-2-cyclobutyl-1-methylimidazole-4-carbonitrile

Drug info:

PubChemData

Smile

CC(C1=CCCO1)(C2=CC(=CC=C2)OC)N

DOS

IR

Vibrations