Geometry & MOs

Info

ID:	363084
PubChem CID:	127310115
Reduced:	O2N5C16H21 (1)
Stoich.:	A2B5C16D21 (1)
Weight, g/mol:	380.221226
ΔH_f, kcal/mol:	11.98
Dipole, Da:	8.06
IP(EA), eV:	-8.97(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-tert-butyl-1H-indol-2-yl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)C3=NNC(=C3)C4CC4

DOS

IR

Vibrations