Geometry & MOs

Info

ID:	201231
PubChem CID:	79509275
Reduced:	O2N3C13H17 (1)
Stoich.:	A2B3C13D17 (1)
Weight, g/mol:	218.153147
ΔH_f, kcal/mol:	-29.94
Dipole, Da:	2.91
IP(EA), eV:	-8.73(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1-propan-2-yl-5-pyridin-4-yl-4H-imidazol-2-amine

Drug info:

PubChemData

Smile

CCN1C(=NCC1(C)C2=CC3=C(C=C2)OCO3)N

DOS

IR

Vibrations