Geometry & MOs

Info

ID:	365567
PubChem CID:	127318048
Reduced:	O4N5C14H25 (1)
Stoich.:	A4B5C14D25 (1)
Weight, g/mol:	315.198048
ΔH_f, kcal/mol:	-178.11
Dipole, Da:	5.75
IP(EA), eV:	-8.59(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-morpholin-4-ylbutan-2-yl)-3-(thian-4-ylmethyl)urea

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)NCCN2C(=O)CNC2=O

DOS

IR

Vibrations