Geometry & MOs

Info

ID:	363083
PubChem CID:	127310114
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	315.169525
ΔH_f, kcal/mol:	-108.42
Dipole, Da:	5.3
IP(EA), eV:	-8.91(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-cyclopropyl-1H-pyrazol-3-yl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)CSCC(=O)N3CCCCC3

DOS

IR

Vibrations