Geometry & MOs

Info

ID:	350999
PubChem CID:	127279436
Reduced:	FON2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	345.191323
ΔH_f, kcal/mol:	-96.72
Dipole, Da:	6.06
IP(EA), eV:	-8.64(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-3-[4-(tetrazol-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)NC(=O)N2CCCC2(C)C

DOS

IR

Vibrations