Geometry & MOs

Info

ID:	330631
PubChem CID:	127248038
Reduced:	O2N5C18H23 (1)
Stoich.:	A2B5C18D23 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-21.93
Dipole, Da:	7.43
IP(EA), eV:	-9.27(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-hydroxy-3-(morpholin-4-ylmethyl)pyrrolidin-1-yl]-(4-methylphenyl)methanone

Drug info:

PubChemData

Smile

C1CCN(C1)CC2(CCN(C2)C(=O)C3=CN=C(C=C3)N4C=CN=C4)O

DOS

IR

Vibrations