Geometry & MOs

Info

ID:	369518
PubChem CID:	127334288
Reduced:	O2N4C19H34 (1)
Stoich.:	A2B4C19D34 (1)
Weight, g/mol:	395.232125
ΔH_f, kcal/mol:	-123.18
Dipole, Da:	6.45
IP(EA), eV:	-8.86(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(6-methylpyridazin-3-yl)amino]phenyl]-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)NC1CCN2C1CCCC2)NC(=O)N3CCCC3

DOS

IR

Vibrations