Geometry & MOs

Info

ID:	271368
PubChem CID:	103670448
Reduced:	N3O4C11H11 (1)
Stoich.:	A3B4C11D11 (1)
Weight, g/mol:	216.147393
ΔH_f, kcal/mol:	-73.68
Dipole, Da:	5.68
IP(EA), eV:	-9.36(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-3-(2-hydroxy-4-methoxy-2-methylbutyl)urea

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)NCC2=NOC=N2)O

DOS

IR

Vibrations