Geometry & MOs

Info

ID:	265137
PubChem CID:	103511370
Reduced:	N3O3C9H13 (1)
Stoich.:	A3B3C9D13 (1)
Weight, g/mol:	213.111341
ΔH_f, kcal/mol:	-98.42
Dipole, Da:	2.82
IP(EA), eV:	-9.79(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-dihydroxy-2-methylpropan-2-yl)-3-methylimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)N2C[C@H]([C@H](C2)O)O

DOS

IR

Vibrations