Geometry & MOs

Info

ID:	184118
PubChem CID:	77112845
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	151.110947
ΔH_f, kcal/mol:	-75.44
Dipole, Da:	4.69
IP(EA), eV:	-9.82(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methylimidazol-4-yl)but-3-en-1-amine

Drug info:

PubChemData

Smile

CC(CCO)CNC(=O)C1=CC(=O)C2C=CC=CC2=N1

DOS

IR

Vibrations