Geometry & MOs

Info

ID:	363248
PubChem CID:	127310389
Reduced:	O3N4C17H28 (1)
Stoich.:	A3B4C17D28 (1)
Weight, g/mol:	377.188546
ΔH_f, kcal/mol:	-115.89
Dipole, Da:	8.24
IP(EA), eV:	-8.9(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-methylpyrazol-1-yl)methyl]-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NC(C)CC3CCCO3

DOS

IR

Vibrations