Geometry & MOs

Info

ID:	312435
PubChem CID:	126604897
Reduced:	PO2C20H41 (1)
Stoich.:	AB2C20D41 (1)
Weight, g/mol:	189.126598
ΔH_f, kcal/mol:	-186.1
Dipole, Da:	2.84
IP(EA), eV:	-8.98(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5,6-dimethylpyrrolo[1,2-b]pyridazin-7-yl)ethanamine

Drug info:

PubChemData

Smile

CC(C)(C)CC(C)(C(=O)CC(C)(C)CCCP(C)O)C(C)(C)C

DOS

IR

Vibrations