Geometry & MOs

Info

ID:	363264
PubChem CID:	127310405
Reduced:	O3N5C18H29 (1)
Stoich.:	A3B5C18D29 (1)
Weight, g/mol:	391.204196
ΔH_f, kcal/mol:	-112.28
Dipole, Da:	6.35
IP(EA), eV:	-9.1(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NCC3CCN(CC3)C(=O)C

DOS

IR

Vibrations