Geometry & MOs

Info

ID:	432186
PubChem CID:	135172318
Reduced:	O2N3C13H17 (1)
Stoich.:	A2B3C13D17 (1)
Weight, g/mol:	313.163771
ΔH_f, kcal/mol:	-60.2
Dipole, Da:	5.02
IP(EA), eV:	-8.56(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[(1-hydroxy-3-methoxy-3-oxopropyl)amino]-2-methyl-5-propan-2-ylimidazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC1=CC=CC2=CN=CN21

DOS

IR

Vibrations