Geometry & MOs

Info

ID:	196362
PubChem CID:	78815041
Reduced:	N3O4C14H23 (1)
Stoich.:	A3B4C14D23 (1)
Weight, g/mol:	386.141262
ΔH_f, kcal/mol:	-173.73
Dipole, Da:	2.36
IP(EA), eV:	-9.54(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCC(=O)OCC1=CN(N=C1)C

DOS

IR

Vibrations