Geometry & MOs

Info

ID:	363125
PubChem CID:	127310158
Reduced:	N3O3C15H23 (1)
Stoich.:	A3B3C15D23 (1)
Weight, g/mol:	373.247775
ΔH_f, kcal/mol:	-75.43
Dipole, Da:	5.18
IP(EA), eV:	-9.04(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-tert-butyl-5-propan-2-ylpyrazol-3-yl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)COCC3CC3

DOS

IR

Vibrations