Geometry & MOs

Info

ID:	420517
PubChem CID:	135113559
Reduced:	N3O3C19H31 (1)
Stoich.:	A3B3C19D31 (1)
Weight, g/mol:	392.151826
ΔH_f, kcal/mol:	-113.61
Dipole, Da:	3.38
IP(EA), eV:	-9.42(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-methyl-2-phenyl-1H-imidazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2O)CCC(=O)NC3CCCCCC3

DOS

IR

Vibrations