Geometry & MOs

Info

ID:	347389
PubChem CID:	127272238
Reduced:	N2O2C17H24 (1)
Stoich.:	A2B2C17D24 (1)
Weight, g/mol:	373.236542
ΔH_f, kcal/mol:	-98.14
Dipole, Da:	4.61
IP(EA), eV:	-9.49(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3-[(1-morpholin-4-ylcyclohexyl)methyl]urea

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations