Geometry & MOs

Info

ID:	370055
PubChem CID:	127337285
Reduced:	ON3C10H17 (2)
Stoich.:	AB3C10D17 (2)
Weight, g/mol:	393.172228
ΔH_f, kcal/mol:	-69.16
Dipole, Da:	6.32
IP(EA), eV:	-8.45(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohex-3-en-1-yl-3-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]urea

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)NCC3CN(CCO3)CC(C)C

DOS

IR

Vibrations