Geometry & MOs

Info

ID:	363456
PubChem CID:	127311259
Reduced:	O3N6C16H24 (1)
Stoich.:	A3B6C16D24 (1)
Weight, g/mol:	291.115381
ΔH_f, kcal/mol:	-110.77
Dipole, Da:	6.93
IP(EA), eV:	-9.96(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[(4-propan-2-yl-1,2,4-triazol-3-yl)methyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C=NN=C1CNC(=O)CCN2C(=O)C3(CCCC3)NC2=O

DOS

IR

Vibrations