Geometry & MOs

Info

ID:	265149
PubChem CID:	103511745
Reduced:	N3O3C14H23 (1)
Stoich.:	A3B3C14D23 (1)
Weight, g/mol:	283.132077
ΔH_f, kcal/mol:	-140.12
Dipole, Da:	3.53
IP(EA), eV:	-9.65(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(4-hydroxybut-1-ynyl)-3-methylphenyl]-3-methylimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C(=O)OC(C)(C)C)NC(=O)C1=CN=CN1C

DOS

IR

Vibrations